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National Natural Science Foundation of China (NSFC) General Program 2023-202850
National Natural Science Foundation of Tianjin, China (NSFC) Youth Program 2023-2025 6
Hundreds of Young Academic Leaders Training Program of Nankai University2025-2028 50
National Natural Science Foundation of China (NSFC) Major Program (Sub-Project)2023-202760
National Key R&D Program (Young Scientists Project) (Sub-Project)2022-202760
National Natural Science Foundation of China (NSFC) Youth Program2022-202430
China Postdoctoral Science Foundation (General Program)2019-20218
(1) Wang, Y.#; Jin, D.#;Ren, L.; Wang, N.; Jia, Y.; Zheng, Z.; Cai, W.; Fu, H.*; Li, G.* J.Am. Chem. Soc. 2025, 147 (7), 5828–5838.
(2) Zhou, H.; Fu, H.*; Shao,X.*; Cai, W.* Int. J. Biol. Macromol. 2025, 304, 140989.
(3) Shao, D.; Zhang, Z.; Liu, X., Fu,H.*; Shao, X.*; Cai, W.* J. Chem. Theory Comput. 2024, 20(23), 10393−10405.
(4) Fu, H.*; Zhou, M.; Chipot, C.; Cai, W.* J. Phys. Chem. B 2024,128 (40), 9706−9713.
(5) Bian, H.; Shao, X.; Cai, W.; Fu,H.* J. Phys. Chem. B 2024, 128 (15), 3598–3604.
(6) Fu, H.; Bian, H.; Shao, X.*; Cai, W.* J. Phys. Chem. Lett. 2024,15 (6), 1774–1783.
(7) Zhou, H.; Fu, H.*; Shao,X.; Cai, W.* J. Chem. Inf. Model. 2023, 63 (24), 7837–7846.
(8) Fu, H.#; Liu,H.#; Xing, J.; Zhao,T.; Shao, X.*; Cai, W.* J. Phys. Chem. B 2023, 127 (46),9926–9935.
(9) Fu, H.*; Chipot, C.; Shao, X.; Cai, W. J. Phys. Chem. B 2023,127 (49), 10459−10468.
(10)Fu, H.; Chipot, C.; Shao, X.*; Cai, W.* J. Chem. Inf. Model. 2023,63 (8), 2512–2519.
(11)Fu, H.; Chen, H.; Blazhynska, M.; Goulard Coderc de Lacam, E.;Szczepaniak, F.; Pavlova, A.; Shao, X.; Gumbart, J. C.; Dehez, F.; Roux, B.;Cai, W.*; Chipot, C.* Nat. Protoc. 2022, 17 (4), 1114–1141.
(12)Fu, H.#; Zhou, Y.#; Jing, X.; Shao, X.*; Cai, W.* J. Med.Chem. 2022, 65 (19), 12970–12978.
(13)Fu, H.; Shao, X.*; Cai, W.* Phys. Chem. Chem. Phys. 2022, 24(3), 1286–1299.
(14)Fu, H.; Chipot, C.; Cai, W.*; Shao, X.* J. Phys. Chem. Lett. 2021,12 (1), 613–619.
(15)Fu, H.; Chen, H.; Cai, W.*; Shao, X.*; Chipot, C.* J. Chem. Inf. Model.2021, 61 (5), 2116–2123.
(16)Fu, H.; Chen, H.; Zhang H.; Shao, X.*; Cai, W.* Acta Chim. Sin. 2021,79 (4), 472–480.
(17)Liu, H.#; Fu, H.#;Shao, X.*; Cai, W.*; Chipot, C.* J. Chem. Theory Comput. 2020, 16(10), 6397–6407.
(18)Fu, H.#; Chen, H.#; Wang, X.; Chai, H.; Shao, X.*; Cai, W.*;Chipot, C.* J. Chem. Inf. Model. 2020, 60 (11), 5366–5374.
(19)Fu, H.; Shao, X.; Cai, W.*; Chipot, C.* Acc. Chem. Res. 2019,52 (11), 3254–3264.
(20)Du, S.#; Fu, H.#;Shao, X.; Chipot, C.; Cai, W.* J. Chem. Theory Comput. 2019, 15(3), 1841–1847.
(21)Zhang, P.#; Fu,H.#; Du, S.; Wang, F.; Yang, J.; Cai, W.*; Liu, D.* Anal.Chem. 2019, 91 (24), 15740–15747.
(22)Fu, H.; Zhang, H.; Chen, H.; Shao, X.; Chipot, C.*; Cai, W.* J. Phys.Chem. Lett. 2018, 9 (16), 4738–4745.
(23)Fu, H.; Gumbart, J. C.; Chen, H.; Shao, X.; Cai, W.*; Chipot, C.* J.Chem. Inf. Model. 2018, 58 (3), 556–560.
(24)Fu, H.; Shao, X.; Chipot, C.; Cai, W.* Chem. Sci. 2017, 8(7), 5087–5094.
(25)Fu, H.; Cai, W.*; Hénin, J.; Roux, B.; Chipot, C.* J. Chem. TheoryComput. 2017, 13 (11), 5173–5178.
(26)Zhao, T.#; Fu, H.#;Lelièvre, T.; Shao, X.; Chipot, C.*; Cai, W.* J. Chem. Theory Comput. 2017,13 (4), 1566–1576.
(27)Fu, H.; Shao, X.; Chipot, C.*; Cai, W.* J. Chem. Theory Comput. 2016,12 (8), 3506–3513.
(28)Fu, H.; Chipot, C.; Shao, X.; Cai, W.* RSC Adv. 2015, 5(116), 95682–95689.
(29)Fu, H.#; Comer, J.#; Cai, W.; Chipot, C.* J. Phys. Chem. Lett.2015, 6 (3), 413–418.
(30)Fu, H.; Liu, Y.; Adrià, F.; Shao, X.; Cai, W.*; Chipot, C.* J. Phys.Chem. B 2014, 118 (40), 11747–11756.
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